2-[4-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)imidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)imidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)imidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[4-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)-2-imidazolyl]thio]acetic acid IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)imidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[[4-(1,3-benzothiazol-2-yl)-1-(4-fluorophenyl)imidazol-2-yl]thio]acetic acid Formula: C18H12FN3O2S2 MolecularWeight: 385.435183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CN(C(=N3)SCC(=O)O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CN(C(=N3)SCC(=O)O)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H12FN3O2S2/c19-11-5-7-12(8-6-11)22-9-14(21-18(22)25-10-16(23)24)17-20-13-3-1-2-4-15(13)26-17/h1-9H,10H2,(H,23,24)